General Information of the Compound
| Compound ID |
CP0437304
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| Compound Name |
2-(4-ethylpiperazin-1-yl)-5-(4-methoxyphenyl)-1,3,4-thiadiazole
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| Structure |
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| Formula |
C15H20N4OS
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| Molecular Weight |
304.419
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| Canonical SMILES |
CCN1CCN(CC1)c1nnc(s1)-c1ccc(OC)cc1
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| InChI |
InChI=1S/C15H20N4OS/c1-3-18-8-10-19(11-9-18)15-17-16-14(21-15)12-4-6-13(20-2)7-5-12/h4-7H,3,8-11H2,1-2H3
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| InChIKey |
VGMZCKLYZUNCTF-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound